P   LATTICE,NONEQUIV.ATOMS   6   57 Pbcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.162493 17.799897 18.244928 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.71508000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.28492000 Y=0.75000000 Z=0.00000000
      -1: X=0.71508000 Y=0.25000000 Z=0.50000000
      -1: X=0.28492000 Y=0.75000000 Z=0.50000000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.05793000 Y=0.16477000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.94207000 Y=0.83523000 Z=0.75000000
      -2: X=0.94207000 Y=0.66477000 Z=0.25000000
      -2: X=0.05793000 Y=0.33523000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 2.00        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33819000 Y=0.37444000 Z=0.13403000
          MULT= 8          ISPLIT= 8
      -3: X=0.66181000 Y=0.62556000 Z=0.86597000
      -3: X=0.33819000 Y=0.37444000 Z=0.36597000
      -3: X=0.66181000 Y=0.62556000 Z=0.63403000
      -3: X=0.66181000 Y=0.87444000 Z=0.13403000
      -3: X=0.33819000 Y=0.12556000 Z=0.86597000
      -3: X=0.66181000 Y=0.87444000 Z=0.36597000
      -3: X=0.33819000 Y=0.12556000 Z=0.63403000
P          NPT=  781  R0=.000100000 RMT= 2.00        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.24570000 Y=0.02712000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -4: X=0.75430000 Y=0.97288000 Z=0.75000000
      -4: X=0.75430000 Y=0.52712000 Z=0.25000000
      -4: X=0.24570000 Y=0.47288000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 2.00        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.41626000 Y=0.18292000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.58374000 Y=0.81708000 Z=0.75000000
      -5: X=0.58374000 Y=0.68292000 Z=0.25000000
      -5: X=0.41626000 Y=0.31708000 Z=0.75000000
P          NPT=  781  R0=.000100000 RMT= 2.00        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.10559000 Y=0.32487000 Z=0.08915000
          MULT= 8          ISPLIT= 8
      -6: X=0.89441000 Y=0.67513000 Z=0.91085000
      -6: X=0.10559000 Y=0.32487000 Z=0.41085000
      -6: X=0.89441000 Y=0.67513000 Z=0.58915000
      -6: X=0.89441000 Y=0.82487000 Z=0.08915000
      -6: X=0.10559000 Y=0.17513000 Z=0.91085000
      -6: X=0.89441000 Y=0.82487000 Z=0.41085000
      -6: X=0.10559000 Y=0.17513000 Z=0.58915000
P          NPT=  781  R0=.000100000 RMT= 2.00        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000